Germakhellin
TL;DR: Germakhellin (CAS 77416-69-4) is a chemical compound with molecular formula C48H62N8O12S2 and molecular weight 1006.39 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,9-dimethoxy-7-methyl-3-(piperazin-1-ylmethyl)furo[3,2-g]chromen-5-one;7-(2-hydroxypropyl)-1,3-dimethylpurine-2,6-dione;methyl sulfate;trimethyl(1-phenothiazin-10-ylpropan-2-yl)azanium
Also Known As: Germakhellin, 10H-Phenothiazine-10-ethanaminium, N,N,N,alpha-tetramethyl-, methyl sulfate, mixt. with 3,7-dihydro-7-(2-hydroxypropyl)-1,3-dimethyl-1H-purine-2,6-dione and 4,9-dimethoxy-7-methyl-3-(1-piperazinylmethyl)-5H-furo(3,2-g)(1)benzopyran-5-one, 4,9-dimethoxy-7-methyl-3-(piperazin-1-ylmethyl)furo[3,2-g]chromen-5-one,7-(2-hydroxypropyl)-1,3-dimethylpurine-2,6-dione,methyl sulfate,trimethyl(1-phenothiazin-10-ylpropan-2-yl)azanium, 4,9-dimethoxy-7-methyl-3-(piperazin-1-ylmethyl)furo[3,2-g]chromen-5-one; 7-(2-hydroxypropyl)-1,3-dimethyl-purine-2,6-dione; methyl sulfate; trimethyl-(1-methyl-2-phenothiazin-10-yl-ethyl)ammonium, 4,9-dimethoxy-7-methyl-3-(piperazin-1-ylmethyl)furo[3,2-g]chromen-5-one; 7-(2-hydroxypropyl)-1,3-dimethylpurine-2,6-dione; methyl sulfate; trimethyl(1-phenothiazin-10-ylpropan-2-yl)azanium
| Molecular Formula | C48H62N8O12S2 |
|---|---|
| Molecular Weight | 1006.39 g/mol |
| LogP | 4.56152 |
| Topological Polar Surface Area | 255.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 17 |
| Rotatable Bonds | 9 |
| Exact Mass | 1006.3929 |
| Heavy Atoms | 70 |
| Complexity | 1330.0 |
Chemical Identifiers
| CAS Number | 77416-69-4 |
|---|---|
| SMILES | CC1=CC(=O)C2=C(O1)C(=C3C(=C2OC)C(=CO3)CN4CCNCC4)OC.CC(CN1C2=CC=CC=C2SC3=CC=CC=C31)[N+](C)(C)C.CC(CN1C=NC2=C1C(=O)N(C(=O)N2C)C)O.COS(=O)(=O)[O-] |
| InChIKey | WOKGFRJKPFZWFR-UHFFFAOYSA-M |
Product Overview
Germakhellin (CAS 77416-69-4), with molecular formula C48H62N8O12S2 and molecular weight 1006.39 g/mol. IUPAC: 4,9-dimethoxy-7-methyl-3-(piperazin-1-ylmethyl)furo[3,2-g]chromen-5-one;7-(2-hydroxypropyl)-1,3-dimethylpurine-2,6-dione;methyl sulfate;trimethyl(1-phenothiazin-10-ylpropan-2-yl)azanium.
Chemical Property Profile of Germakhellin
Property Insights of Germakhellin
The XLogP value of 4.56152 indicates that Germakhellin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 255.0 Ų indicates high polarity, suggesting Germakhellin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Germakhellin has 2 hydrogen bond donor(s) and 17 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Germakhellin?
The CAS number of Germakhellin is 77416-69-4.
What is the molecular formula of Germakhellin?
The molecular formula of Germakhellin is C48H62N8O12S2.
What is the molecular weight of Germakhellin?
The molecular weight of Germakhellin is 1006.39 g/mol.
Where can I buy Germakhellin?
You can request a quote for Germakhellin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Germakhellin?
Yes, KEHONG BIO provides custom synthesis services for Germakhellin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.